SCHEMBL2768573

SCHEMBL2768573

CSc1ccc(NC(=O)N(S)c2noc3cccc(N(C)C)c23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.40
PTGS2 P35354 2/20 0.38
KIT P10721 5/20 0.36
KDR P35968 5/20 0.36
FLT3 P36888 4/20 0.36
HIF1A Q16665 2/20 0.36
AURKB Q96GD4 4/20 0.36
MAOB P27338 2/20 0.35
MAOA P21397 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ABL1 P00519 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
CSF1R P07333 1/20 0.33
LYN P07948 1/20 0.33
SRC P12931 1/20 0.33
FLT1 P17948 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2770452 0.90 SMN1; SMN2 (0.42) HIF1AALDH1A1MAPTNPC1RAB9A
SCHEMBL2768720 0.85 KIT (0.48) NOX1KITKDRHIF1AALDH1A1
SCHEMBL2770801 0.83 ALDH1A1 (0.42) ALDH1A1MAPTKDM4ENPC1RAB9A
SCHEMBL2768388 0.83 KIT (0.44) KITKDRFLT3HIF1AAURKB
SCHEMBL2768565 0.83 MAPT (0.43) ALDH1A1LMNAMAPTKDM4ENPC1
SCHEMBL2769970 0.80 HIF1A (0.49) KITKDRHIF1AALDH1A1MAPT
SCHEMBL2769354 0.76 MAPT (0.48) HIF1AMAOBALDH1A1MAPTKDM4E
SCHEMBL2769331 0.75 RAB9A (0.36) HIF1AMAOBALDH1A1LMNAMAPT
SCHEMBL2768567 0.75 IDO1 (0.42) NOX1PTGS2KITKDRFLT3
SCHEMBL2785840 0.72 NOX1 (0.36) NOX1PTGS2KITKDRFLT3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1881967-B1 SUBSTITUTED BENZO(D)ISOXAZOL-3-YL AMINE COMPOUNDS AS ANALGESICS GRUENENTHAL GMBH (DE) 2010-04-28 EP claimed
US-20080176915-A1 Substituted Benzo[d]isoxazol-3-yl Amine Compounds as Analgesics GRUENENTHAL GMBH (DE) 2008-07-24 US claimed
US-7696238-B2 Substituted benzo[d]isoxazol-3-yl amine compounds as analgesics GRUENENTHAL GMBH (DE) 2010-04-13 US disclosed
US-20080176915-A1 Substituted Benzo[d]isoxazol-3-yl Amine Compounds as Analgesics GRUENENTHAL GMBH (DE) 2008-07-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080176915-A1 Substituted Benzo[d]isoxazol-3-yl Amine Compounds as Analgesics KCNQ1, KCNQ2, KCNQ3 NOX1 4071/4885PTGS2 624/4885KIT 2633/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.